7-[(3-bromophenyl)carbonylamino]heptanoic acid

Systemtic Name: 7-[(3-bromophenyl)carbonylamino]heptanoic acid Openeye Name: 7-[(3-bromobenzoyl)amino]heptanoic acid CAS Name: 7-[[(3-bromophenyl)-oxomethyl]amino]heptanoic acid IUPAC Name: 7-[(3-bromobenzoyl)amino]heptanoic acid Traditional Name: 7-[(3-bromobenzoyl)amino]enanthic acid Formula: C14H18BrNO3 MolecularWeight: 328.20162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C14H18BrNO3/c15-12-7-5-6-11(10-12)14(19)16-9-4-2-1-3-8-13(17)18/h5-7,10H,1-4,8-9H2,(H,16,19)(H,17,18)